| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:37:20 UTC |
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| Update Date | 2025-03-21 17:57:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00009255 |
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| Frequency | 529.4 |
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| Structure | |
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| Chemical Formula | C8H9NO |
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| Molecular Mass | 135.0684 |
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| SMILES | Cc1ccc(C(N)=O)cc1 |
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| InChI Key | UHBGYFCCKRAEHA-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | benzoic acids and derivatives |
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| Direct Parent | benzamides |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | benzoyl derivativescarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsprimary carboxylic acid amidesp-toluamides |
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| Substituents | primary carboxylic acid amidebenzoylcarboxamide groupcarboxylic acid derivativetoluamidebenzamidep-toluamidearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundtolueneorganooxygen compound |
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